(3S)-5-nitro-3-oxidanyl-3-[4-phenyl-2-(prop-2-enylamino)-1,3-thiazol-5-yl]-1H-indol-2-one

Systemtic Name: (3S)-5-nitro-3-oxidanyl-3-[4-phenyl-2-(prop-2-enylamino)-1,3-thiazol-5-yl]-1H-indol-2-one Openeye Name: (3S)-3-[2-(allylamino)-4-phenyl-thiazol-5-yl]-3-hydroxy-5-nitro-indolin-2-one CAS Name: (3S)-3-hydroxy-5-nitro-3-[4-phenyl-2-(prop-2-enylamino)-5-thiazolyl]-1H-indol-2-one IUPAC Name: (3S)-3-hydroxy-5-nitro-3-[4-phenyl-2-(prop-2-enylamino)-1,3-thiazol-5-yl]-1H-indol-2-one Traditional Name: (3S)-3-[2-(allylamino)-4-phenyl-thiazol-5-yl]-3-hydroxy-5-nitro-oxindole Formula: C20H16N4O4S MolecularWeight: 408.43044

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=C(S1)C2(C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)O)C4=CC=CC=C4

Isomeric SMILES

C=CCNC1=NC(=C(S1)[C@@]2(C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)O)C4=CC=CC=C4

InChI

InChI=1S/C20H16N4O4S/c1-2-10-21-19-23-16(12-6-4-3-5-7-12)17(29-19)20(26)14-11-13(24(27)28)8-9-15(14)22-18(20)25/h2-9,11,26H,1,10H2,(H,21,23)(H,22,25)/t20-/m1/s1